(2S)-N-{2-[4-(2-chloroacetyl)piperazin-1-yl]-1-phenylethyl}-2-acetamido-3-(4-hydroxyphenyl)propanamide hydrochloride

Compound number
MolPort-047-547-876
IUPAC
(2S)-N-{2-[4-(2-chloroacetyl)piperazin-1-yl]-1-phenylethyl}-2-acetamido-3-(4-hydroxyphenyl)propanamide hydrochloride
IUPAC traditional
(2S)-N-{2-[4-(2-chloroacetyl)piperazin-1-yl]-1-phenylethyl}-2-acetamido-3-(4-hydroxyphenyl)propanamide hydrochloride
SMILES
Cl.CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NC(CN1CCN(CC1)C(=O)CCl)c1ccccc1
InChI key
LERWAAVXZNBRIV-OSMMWLIYSA-N
Molecular formula
Molecular weight
523.46
Solubility
not available

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Compound identifiers

Compound number
MolPort-047-547-876

Names, Synonyms and 3rd Party Identifiers

InChI

InChI
1/C25H31ClN4O4.ClH/c1-18(31)27-22(15-19-7-9-21(32)10-8-19)25(34)28-23(20-5-3-2-4-6-20)17-29-11-13-30(14-12-29)24(33)16-26;/h2-10,22-23,32H,11-17H2,1H3,(H,27,31)(H,28,34);1H/t22-,23?;/m0./s1
InChI key
LERWAAVXZNBRIV-OSMMWLIYSA-N

Formula

Molecular formula
C25H32Cl2N4O4
Molecular weight
523.46

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